BioLiP

PDB

BioLiP

PDB CCD ID:

9HH

Number of entries in BioLiP:

Chemical formula:

C19 H16 N2 O2 S

InChI:

InChI=1S/C19H16N2O2S/c1-24(22,23)21-18-12-5-3-8-14(18)16-10-6-9-15-13-7-2-4-11-17(13)20-19(15)16/h2-12,20-21H,1H3

InChIKey:

FKXDARRJLQDNOV-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385	C[S](=O)(=O)Nc1ccccc1c2cccc3c2[nH]c4ccccc34
OpenEye OEToolkits 2.0.6	CS(=O)(=O)Nc1ccccc1c2cccc3c2[nH]c4c3cccc4

Name:

~{N}-[2-(9~{H}-carbazol-1-yl)phenyl]methanesulfonamide

ChEMBL:

CHEMBL4228040

Reference:

Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).

Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).